[2-[(2-methoxy-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] N,N-dimethylcarbamodithioate

Systemtic Name: [2-[(2-methoxy-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] N,N-dimethylcarbamodithioate Openeye Name: [2-(2-methoxy-5-nitro-anilino)-2-oxo-ethyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [2-(2-methoxy-5-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methoxy-5-nitroanilino)-2-oxoethyl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [2-keto-2-(2-methoxy-5-nitro-anilino)ethyl] ester Formula: C12H15N3O4S2 MolecularWeight: 329.3952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)SCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC

Isomeric SMILES

CN(C)C(=S)SCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC

InChI

InChI=1S/C12H15N3O4S2/c1-14(2)12(20)21-7-11(16)13-9-6-8(15(17)18)4-5-10(9)19-3/h4-6H,7H2,1-3H3,(H,13,16)